SCHEMBL6984146

SCHEMBL6984146

CC(C)n1nc(-c2c(O)cnn2-c2ccccc2)ccc1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.42
ALDH1A1 P00352 5/20 0.37
GAA P10253 1/20 0.37
PPARG P37231 2/20 0.36
NCOA2 Q15596 2/20 0.36
NCOA1 Q15788 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
RIPK2 O43353 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
MAPT P10636 2/20 0.34
BLM P54132 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
POLB P06746 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6987843 0.86 HIF1A (0.43) HIF1AALDH1A1GAAPPARGNCOA2
SCHEMBL6983980 0.83 HIF1A (0.40) HIF1AALDH1A1GAAPPARGNCOA2
SCHEMBL6984135 0.80 TSHR (0.39) HIF1AALDH1A1PPARGNCOA2NCOA1
SCHEMBL6989271 0.78 HIF1A (0.36) HIF1AALDH1A1GAAPPARGNCOA2
SCHEMBL6985009 0.76 ALDH1A1 (0.38) HIF1AALDH1A1TSHRHTTSMN1; SMN2
SCHEMBL6986371 0.76 ALDH1A1 (0.41) ALDH1A1GAAKMT2ATSHRTP53
SCHEMBL6981881 0.75 PDE10A (0.43) ALDH1A1GAATSHRTP53POLB
SCHEMBL6984199 0.72 NPC1 (0.42) HIF1AALDH1A1GAAKMT2ATSHR
SCHEMBL6984311 0.72 MAPK14 (0.44) POLB
SCHEMBL6987355 0.71 ALDH1A1 (0.38) ALDH1A1GAAKMT2ATSHRTP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313733-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP disclosed
WO-2002018382-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-07 WO disclosed